From 8a36cdc6bc6a1b537efdbaf1ef1ceb889a1fe068 Mon Sep 17 00:00:00 2001 From: Axel Kohlmeyer <akohlmey@gmail.com> Date: Wed, 13 Dec 2017 18:42:24 -0500 Subject: [PATCH] correct velocity output for write_data of atom style smd --- src/USER-SMD/atom_vec_smd.cpp | 3 +-- 1 file changed, 1 insertion(+), 2 deletions(-) diff --git a/src/USER-SMD/atom_vec_smd.cpp b/src/USER-SMD/atom_vec_smd.cpp index 07d526ba31..8bffaf8a09 100644 --- a/src/USER-SMD/atom_vec_smd.cpp +++ b/src/USER-SMD/atom_vec_smd.cpp @@ -1215,8 +1215,7 @@ int AtomVecSMD::pack_vel_hybrid(int i, double *buf) { void AtomVecSMD::write_vel(FILE *fp, int n, double **buf) { for (int i = 0; i < n; i++) fprintf(fp, TAGINT_FORMAT - " %-1.16e %-1.16e %-1.16e %-1.16e %-1.16e %-1.16e\n", (tagint) ubuf(buf[i][0]).i, buf[i][1], buf[i][2], buf[i][3], - buf[i][4], buf[i][5], buf[i][6]); + " %-1.16e %-1.16e %-1.16e\n", (tagint) ubuf(buf[i][0]).i, buf[i][1], buf[i][2], buf[i][3]); } /* ---------------------------------------------------------------------- -- GitLab